Molecule ID: mol31504

SMILES: C[n+]1[nH]ccc1/C=N/O

InChI: InChI=1S/C5H7N3O/c1-8-5(4-7-9)2-3-6-8/h2-4H,1H3,(H,6,9)/p+1

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
7.60 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization